Summary

IMPPAT Phytochemical identifier: IMPHY001433

Phytochemical name: budmunchiamine G

Synonymous chemical names:
budmunchiamine g

External chemical identifiers:
CID:15337611, ChEMBL:CHEMBL469083

---

Chemical structure information

SMILES:
CCCCCCCCCCCCCC1NCCCN(C)CCCCN(CCCNC(=O)C1)C

InChI:
InChI=1S/C28H58N4O/c1-4-5-6-7-8-9-10-11-12-13-14-19-27-26-28(33)30-21-18-25-32(3)23-16-15-22-31(2)24-17-20-29-27/h27,29H,4-26H2,1-3H3,(H,30,33)

InChIKey:
YCWNIHIHFQDYID-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCCCCCCCCNCCCNC)CCCCNCCCNC=O)C%17))))))C

Functional groups:
CN(C)C, CNC, CNC(C)=O

---

Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C1CCNCCCNCCCCNCCCN1

Scaffold Graph/Node level:
OC1CCNCCCNCCCCNCCCN1

Scaffold Graph level:
CC1CCCCCCCCCCCCCCCC1

---

Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Phenylpropanoids and polyketides

ClassyFire Class: Macrolactams

NP Classifier Biosynthetic pathway: Alkaloids

NP Classifier Superclass: Ornithine alkaloids

NP Classifier Class: Polyamines

NP-Likeness score: 0.454

---

Chemical structure download